[8-methyl-2-(4-methylphenyl)-4-oxidanylidene-5H-1,5-benzothiazepin-3-yl] ethanoate

Systemtic Name: [8-methyl-2-(4-methylphenyl)-4-oxidanylidene-5H-1,5-benzothiazepin-3-yl] ethanoate Openeye Name: [8-methyl-4-oxo-2-(p-tolyl)-5H-1,5-benzothiazepin-3-yl] acetate CAS Name: acetic acid [8-methyl-2-(4-methylphenyl)-4-oxo-5H-1,5-benzothiazepin-3-yl] ester IUPAC Name: [8-methyl-2-(4-methylphenyl)-4-oxo-5H-1,5-benzothiazepin-3-yl] acetate Traditional Name: acetic acid [4-keto-8-methyl-2-(p-tolyl)-5H-1,5-benzothiazepin-3-yl] ester Formula: C19H17NO3S MolecularWeight: 339.40818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)NC3=C(S2)C=C(C=C3)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)NC3=C(S2)C=C(C=C3)C)OC(=O)C

InChI

InChI=1S/C19H17NO3S/c1-11-4-7-14(8-5-11)18-17(23-13(3)21)19(22)20-15-9-6-12(2)10-16(15)24-18/h4-10H,1-3H3,(H,20,22)